2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide

C15H18N4O — CID 60868425

IUPAC2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide
SMILESCC(N)(C(=O)Nc1cccc(-n2ccnc2)c1)C1CC1
InChIInChI=1S/C15H18N4O/c1-15(16,11-5-6-11)14(20)18-12-3-2-4-13(9-12)19-8-7-17-10-19/h2-4,7-11H,5-6,16H2,1H3,(H,18,20)
InChIKeyMHGDYORIVHWBOE-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.94
Rot. Bonds4

About 2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide

2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide (PubChem CID 60868425) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide
PubChem CID60868425
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide
SMILESCC(N)(C(=O)Nc1cccc(-n2ccnc2)c1)C1CC1
InChIInChI=1S/C15H18N4O/c1-15(16,11-5-6-11)14(20)18-12-3-2-4-13(9-12)19-8-7-17-10-19/h2-4,7-11H,5-6,16H2,1H3,(H,18,20)
InChIKeyMHGDYORIVHWBOE-UHFFFAOYSA-N
XLogP1.94
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-imidazol-1-ylphenyl)cyclopropanecarboxamide
CID 47215374
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2-amino-N-(3-imidazol-1-ylphenyl)-3-methylbutanamide
CID 43701216
2-amino-2-cyclopropyl-N-[4-(triazol-2-yl)phenyl]propanamide
CID 60867892
3-(cyclopropylamino)-N-(3-imidazol-1-ylphenyl)propanamide
CID 60866705
3-cyclopropyl-N-(3-imidazol-1-ylphenyl)thiophene-2-carboxamide
CID 51095447
N-(3-imidazol-1-ylphenyl)-2-methoxyacetamide
CID 47215494
N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide
CID 60866095
2-amino-N-(3-imidazol-1-ylphenyl)-3-methoxypropanamide
CID 81083217
N-(4-imidazol-1-ylphenyl)-2,2-dimethylpropanamide
CID 37186383
3-(ethylamino)-N-(3-imidazol-1-ylphenyl)propanamide
CID 55121130
2-amino-N-(3-imidazol-1-ylphenyl)hexanamide
CID 60853484

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide?
The IUPAC name of 2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide (CID 60868425) is 2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide.
What is the SMILES notation for 2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide?
The canonical SMILES for 2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide is CC(N)(C(=O)Nc1cccc(-n2ccnc2)c1)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide?
The InChIKey is MHGDYORIVHWBOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-15(16,11-5-6-11)14(20)18-12-3-2-4-13(9-12)19-8-7-17-10-19/h2-4,7-11H,5-6,16H2,1H3,(H,18,20).
What are the key properties of 2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide?
2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide has a molecular weight of 270.34 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-N-(3-imidazol-1-ylphenyl)propanamide is sourced from PubChem (CID 60868425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).